%chk=000201589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201589

0 1
O 0.104186 -1.255958 -1.193798
O 1.505362 1.060245 -1.442195
O -4.723874 1.239580 -0.276300
N 2.277344 -3.142064 0.393597
C 1.210809 -1.031971 -0.283585
C 2.215302 -2.123858 -0.703654
C 1.806411 0.371940 -0.492393
C 2.776380 0.852279 0.539485
C -1.090099 -0.611256 -0.853186
C 3.582644 -3.866838 0.371322
C 1.143160 -4.107782 0.282045
C -1.410266 0.581392 -1.529480
C -1.967329 -1.219593 0.045802
C 3.205914 0.058953 1.613247
C 3.265845 2.163805 0.408068
C -3.541718 0.548505 -0.399693
C -2.647079 1.165567 -1.306341
C -3.217045 -0.632606 0.278967
C -5.746524 0.705546 0.621840
C -6.879952 1.721013 0.478765
C 4.113758 0.573668 2.542826
C 4.171623 2.675866 1.338874
C 4.595961 1.879903 2.407974
C -8.067824 1.340366 1.353132
H 0.848827 -1.151735 0.763611
H 1.890501 -2.537875 -1.688639
H 3.222094 -1.684913 -0.870732
H 3.603342 -4.589199 1.203735
H 3.794663 -4.413020 -0.559602
H 4.398702 -3.147695 0.547487
H 0.196581 -3.554540 0.153396
H 1.224839 -4.820412 -0.552011
H 1.074923 -4.676610 1.222475
H -0.673501 1.020188 -2.210438
H -1.686700 -2.142088 0.548924
H 2.842555 -0.966451 1.734956
H 2.926916 2.776142 -0.433490
H -2.945487 2.084213 -1.807565
H -3.907217 -1.099839 0.972180
H -6.029051 -0.302341 0.276156
H -5.333518 0.666414 1.643067
H -7.182456 1.790679 -0.586589
H -6.506619 2.732388 0.741392
H 4.444330 -0.045319 3.375371
H 4.545627 3.692721 1.231989
H 5.302119 2.277630 3.136291
H -8.478040 0.360372 1.081799
H -8.879860 2.071022 1.248275
H -7.799361 1.305863 2.415645


%chk=000201589-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201589

0 1
O 0.237422 -1.121060 -1.436398
O 1.461415 1.354203 -1.088871
O -5.115420 0.487314 -0.675849
N 2.556617 -3.115640 -0.011779
C 1.271417 -0.994920 -0.411303
C 2.449498 -1.907164 -0.859759
C 1.744143 0.470874 -0.234325
C 2.569516 0.782480 0.984119
C -1.065014 -0.660396 -1.138436
C 3.869833 -3.782596 -0.144653
C 1.434030 -4.060700 -0.212986
C -2.018932 -0.858289 -2.167825
C -1.459217 -0.064285 0.079074
C 2.989662 -0.219482 1.904531
C 2.931713 2.138203 1.214310
C -3.756214 0.130276 -0.756216
C -3.352851 -0.465892 -1.979245
C -2.806061 0.330378 0.271495
C -5.580684 1.120236 0.568949
C -7.072443 1.416818 0.395595
C 3.758303 0.140007 3.032950
C 3.693233 2.491782 2.344741
C 4.107505 1.492021 3.258941
C -7.670848 2.085763 1.652391
H 0.888451 -1.371647 0.559127
H 2.277359 -2.137362 -1.937802
H 3.407879 -1.362618 -0.787946
H 3.928282 -4.624018 0.568657
H 4.058880 -4.188371 -1.169268
H 4.678272 -3.069709 0.097864
H 0.469488 -3.540409 -0.090563
H 1.438337 -4.524108 -1.229789
H 1.491662 -4.866804 0.539789
H -1.692396 -1.315290 -3.106654
H -0.741260 0.123616 0.883168
H 2.743048 -1.276281 1.734921
H 2.600948 2.890308 0.489949
H -4.099970 -0.608656 -2.765718
H -3.087427 0.796088 1.220462
H -5.410653 0.433100 1.425684
H -5.009809 2.056173 0.750069
H -7.600650 0.470270 0.176023
H -7.204676 2.070256 -0.486743
H 4.084557 -0.633484 3.736906
H 3.964937 3.538906 2.517323
H 4.699294 1.765790 4.139809
H -7.569386 1.436024 2.542161
H -8.745889 2.294606 1.510544
H -7.168705 3.045983 1.875579


